BDBM50008557 5-Isopropoxy-6-methoxy-2-methyl-indan-1-one::CHEMBL153848

SMILES: COc1cc2C(=O)C(C)Cc2cc1OC(C)C

InChI Key: InChIKey=LTSJAOJBDFVFJN-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50008557   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Acetylcholinesterase (Homo sapiens (Human))	BDBM50008557 (5-Isopropoxy-6-methoxy-2-methyl-indan-1-one | CHEM...) Show SMILES COc1cc2C(=O)C(C)Cc2cc1OC(C)C Show InChI InChI=1S/C14H18O3/c1-8(2)17-13-6-10-5-9(3)14(15)11(10)7-12(13)16-4/h6-9H,5H2,1-4H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois Curated by ChEMBL					Assay Description IC50 against acetylcholinesterase; value ranges from 1.3-380 nM.				J Med Chem 35: 584-9 (1992) BindingDB Entry DOI: 10.7270/Q20G3J3J
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50008557 (5-Isopropoxy-6-methoxy-2-methyl-indan-1-one | CHEM...) Show SMILES COc1cc2C(=O)C(C)Cc2cc1OC(C)C Show InChI InChI=1S/C14H18O3/c1-8(2)17-13-6-10-5-9(3)14(15)11(10)7-12(13)16-4/h6-9H,5H2,1-4H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.90	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois Curated by ChEMBL					Assay Description IC50 against acetylcholinesterase; value ranges from 1-4900 nM.				J Med Chem 35: 584-9 (1992) BindingDB Entry DOI: 10.7270/Q20G3J3J
					More data for this Ligand-Target Pair